N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-2-fluoranyl-benzamide

Systemtic Name: N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-2-fluoranyl-benzamide Openeye Name: N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-2-fluoro-benzamide CAS Name: N-[[3-[(cyclohexylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-fluorobenzamide IUPAC Name: N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-2-fluorobenzamide Traditional Name: N-[[3-(cyclohexylcarbamoyl)phenyl]thiocarbamoyl]-2-fluoro-benzamide Formula: C21H22FN3O2S MolecularWeight: 399.481683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H22FN3O2S/c22-18-12-5-4-11-17(18)20(27)25-21(28)24-16-10-6-7-14(13-16)19(26)23-15-8-2-1-3-9-15/h4-7,10-13,15H,1-3,8-9H2,(H,23,26)(H2,24,25,27,28)